N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine

C15H24N2O — CID 63785331

IUPACN-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine
SMILESCC(N)Cc1ccccc1N(C)C1CCOCC1
InChIInChI=1S/C15H24N2O/c1-12(16)11-13-5-3-4-6-15(13)17(2)14-7-9-18-10-8-14/h3-6,12,14H,7-11,16H2,1-2H3
InChIKeyBRLAQJQOFAMURT-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.19
Rot. Bonds4

About N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine

N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine (PubChem CID 63785331) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine.

Molecular Properties

Compound NameN-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine
PubChem CID63785331
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine
SMILESCC(N)Cc1ccccc1N(C)C1CCOCC1
InChIInChI=1S/C15H24N2O/c1-12(16)11-13-5-3-4-6-15(13)17(2)14-7-9-18-10-8-14/h3-6,12,14H,7-11,16H2,1-2H3
InChIKeyBRLAQJQOFAMURT-UHFFFAOYSA-N
XLogP2.19
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[(1R)-1-aminopropyl]phenyl]-N-methyloxan-4-amine
CID 113358796
1-[2-[methyl(oxan-4-yl)amino]phenyl]ethanol
CID 43611437
3-fluoro-1-N-methyl-1-N-(oxan-4-yl)benzene-1,2-diamine
CID 60790197
N-[[2-(aminomethyl)phenyl]methyl]-N-methyloxolan-3-amine
CID 63558537
N-[4-[(1S)-1-aminoethyl]phenyl]-N-methyloxan-4-amine
CID 55189766
N-[2-(aminomethyl)-4-(trifluoromethyl)phenyl]-N-methyloxan-4-amine
CID 43610591
N-[2-(2-aminoethyl)-3-chlorophenyl]-N-methyloxan-4-amine
CID 63782228
2-(2-aminopropyl)-5-bromo-N-cyclopentyl-N-methylaniline
CID 63785627
2-(2-aminopropyl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]aniline
CID 63793436
N-[4-(1-aminoethyl)-2-chlorophenyl]-N-methyloxan-4-amine
CID 55130920
4-iodo-1-N-methyl-1-N-(oxan-4-yl)benzene-1,2-diamine
CID 66064700
N-[2-(2-aminoethyl)phenyl]-N,1-dimethylpiperidin-4-amine
CID 63782695

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine?
The IUPAC name of N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine (CID 63785331) is N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine.
What is the SMILES notation for N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine?
The canonical SMILES for N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine is CC(N)Cc1ccccc1N(C)C1CCOCC1.
What is the InChIKey of N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine?
The InChIKey is BRLAQJQOFAMURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12(16)11-13-5-3-4-6-15(13)17(2)14-7-9-18-10-8-14/h3-6,12,14H,7-11,16H2,1-2H3.
What are the key properties of N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine?
N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminopropyl)phenyl]-N-methyloxan-4-amine is sourced from PubChem (CID 63785331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).